[1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole | 145547-85-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: [1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole
• 英文别名: 3,7-dithia-1,5-diazabicyclo[3.3.0]octane；[1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole；[1,3,4]Thiadiazolo[3,4-c][1,3,4]thiadiazol；1H,3H,5H,7H-[1,3,4]Thiadiazolo[3,4-c][1,3,4]thiadiazole；1,3,5,7-tetrahydro-[1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole
• CAS: 145547-85-9
• 化学式: C₄H₈N₂S₂
• 分子量: 148.253
• InChiKey: STIOMZDJYZTBFK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  8
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  57.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole 在 氢溴酸 作用下， 以 乙醚 为溶剂， 反应 3.0h， 以77%的产率得到
  参考文献：
  名称：

  Synthesis of N- and N,N′-coordinated derivatives of 3,7-dithia-1,5-diazabicyclo[3.3.0]octanes and their fungicidal activity

  摘要：

  Possibility of obtaining water-soluble N- and N,N'-coordinated adducts by reacting 3,7-dithia-1,5-diazabicyclo[3.3.0]octane with methyl iodide and Bronsted (HCl, HBr) and Lewis (AlCl3) acids was examined. The fungicidal activity of 3,7-dithia-1,5-diazabicyclo[3.3.0]octane and its water-soluble adducts with hydrobromide and methyl iodide against a number of microscopic fungi affecting cultivated plants and various materials was studied.

  DOI：

  10.1134/s1070427211020108
• 作为产物：
  描述：

  聚合甲醛 在 硫化氢 、 肼 作用下， 以 水 为溶剂， 反应 3.0h， 以76%的产率得到[1,3,4]thiadiazolo[3,4-c][1,3,4]thiadiazole
  参考文献：
  名称：

  Multicomponent heterocyclization of hydrazine, hydrogen sulfide, and formaldehyde

  摘要：

  肼、硫化氢和甲醛的多组分杂环化反应产生了以前未知的双环、三环和四环含氮和含硫杂环。3,7-二硫杂-1,5-二氮杂双环[3.3.0]辛烷、4,9-二硫杂-1,2,6,7-四氮杂三环[5.3.1.12,6]十二烷和 4,9,14-三硫杂-1,2,6,7,11,12-六氮杂四环[10.3.1.12,6.17,11]十八烷根据反应温度（0-60 °C）的不同而有选择性地获得。

  DOI：

  10.1007/s11172-005-0023-z

文献信息

• Cyclocondensation of hydrazine, formaldehyde, and hydrogen sulfide in the presence of acids and bases
  作者：V. R. Akhmetova、G. R. Nadyrgulova、S. R. Khafizova、R. R. Khairullina、E. A. Paramonov、R. V. Kunakova、U. M. Dzhemilev

  DOI：10.1134/s1070428006010246

  日期：2006.1
• Ruehlmann, Journal fur praktische Chemie (Leipzig 1954), 1959, vol. <4> 8, p. 285,289
  作者：Ruehlmann

  DOI：——

  日期：——
• Synthesis of N- and N,N′-coordinated derivatives of 3,7-dithia-1,5-diazabicyclo[3.3.0]octanes and their fungicidal activity
  作者：V. R. Akhmetova、N. N. Murzakova、G. R. Khabibullina、N. F. Galimzyanova

  DOI：10.1134/s1070427211020108

  日期：2011.2

  Possibility of obtaining water-soluble N- and N,N'-coordinated adducts by reacting 3,7-dithia-1,5-diazabicyclo[3.3.0]octane with methyl iodide and Bronsted (HCl, HBr) and Lewis (AlCl3) acids was examined. The fungicidal activity of 3,7-dithia-1,5-diazabicyclo[3.3.0]octane and its water-soluble adducts with hydrobromide and methyl iodide against a number of microscopic fungi affecting cultivated plants and various materials was studied.
• Multicomponent heterocyclization of hydrazine, hydrogen sulfide, and formaldehyde
  作者：S. R. Khafizova、V. R. Akhmetova、T. V. Tyumkina、L. M. Khalilov、R. V. Kunakova、U. M. Dzhemilev

  DOI：10.1007/s11172-005-0023-z

  日期：2004.8

  Multicomponent heterocyclization of hydrazine, hydrogen sulfide, and formaldehyde gave previously unknown bi-, tri-, and tetracyclic nitrogen- and sulfur-containing heterocycles. 3,7-Dithia-1,5-diazabicyclo[3.3.0]octane, 4,9-dithia-1,2,6,7-tetraazatricyclo[5.3.1.12,6]dodecane, and 4,9,14-trithia-1,2,6,7,11,12-hexaazatetracyclo[10.3.1.12,6.17,11]octadecane were obtained selectively, depending on the reaction temperature (0–60 °C).

  肼、硫化氢和甲醛的多组分杂环化反应产生了以前未知的双环、三环和四环含氮和含硫杂环。3,7-二硫杂-1,5-二氮杂双环[3.3.0]辛烷、4,9-二硫杂-1,2,6,7-四氮杂三环[5.3.1.12,6]十二烷和 4,9,14-三硫杂-1,2,6,7,11,12-六氮杂四环[10.3.1.12,6.17,11]十八烷根据反应温度（0-60 °C）的不同而有选择性地获得。